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Chemical ID: 7513715
Chemical ID:
7513715
Name [?]:
2,6-dimethoxy-4-[4-(4-methoxyphenyl)-5-phenyl-1H-imidazol-2-yl]-phenol
SMILES [?]:
COc1ccc(cc1)c2c([nH]c(n2)c3cc(c(c(c3)OC)O)OC)c4ccccc4
InChi [?]:
InChI=1/C24H22N2O4/c1-28-18-11-9-16(10-12-18)22-21(15-7-5-4-6-8-15)25-24(26-22)17-13-19(29-2)23(27)20(14-17)30-3/h4-14,27H,1-3H3,(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,21,24,28,27,29,26,30,5,7,4,8,19,15,25,6,14,3,18,16,10,9,17,12,11,13,22,2,20,23/E:(2,3)(5,6)(7,8)(9,10)(11,12)(13,14)(19,20)(29,30)/rA:30nCOCCCCCCCCNCNCCCCCCOCOOCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s10;s11;s9d12;s12;s14;d15;s16;d17;d14s18;s18;s20;s17;s16;s23;s10;s25;d26;s27;d28;d25s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H22N2O4 |
All Atoms: | 52 |
Heavy Atoms: | 30 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.64665 |
Area: | 624.293 |
Solvation: | -6.96067 |
Coulombic: | -56.7077 |
Bond Count [?]
All: | 33 |
Single: | 22 |
Double: | 11 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.47 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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